DigitalFlask
Stop guessing how your reactions work.
DigitalFlask is your computational laboratory for understanding and optimizing chemical reactions.
What is DigitalFlask?
DigitalFlask is a computational chemistry platform that combines human expertise with computing power to elucidate complex reaction mechanisms. We transform your chemistry questions into detailed simulations that reveal how and why your reactions work.
Key Capabilities
Automated Workflows
Optimized computational pipelines that automatically handle complex quantum mechanics and molecular dynamics calculations.
Reaction Mechanism Analysis
Complete identification of reaction pathways, intermediates, and transition states with detailed analysis of energetic factors.
Interactive Visualization
Explore your reactions in 3D, visualize potential energy surfaces, and intuitively understand the underlying chemistry.
Platform in Action
Explore an interactive demonstration of our platform below. See how we transform your chemistry questions into detailed simulations and actionable insights.
Platform Access
DigitalFlask is currently in private beta. We're working with select partners to refine the platform and demonstrate its value. Contact us to discuss early access.
In Private Beta
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